NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5207 8.1927 115.5565 57.7167 65.1159 173.1193 3 L 5.1165 7.8424 119.1448 52.6258 45.4949 173.8737 4 A 4.7499 10.6000 129.6676 50.2391 21.9457 174.6438 5 I 4.4980 8.4842 123.7528 59.7331 39.2946 174.5814 6 D 5.0122 8.9507 127.5037 52.3193 43.4848 174.8108 7 L 5.3937 8.5420 124.6920 53.0120 45.3099 175.4730 8 E 4.6683 9.4379 122.9999 54.5112 33.5985 174.0243 9 V 4.5173 8.5023 126.0368 61.4319 33.3891 176.0477 10 K 4.4369 8.9411 130.1160 55.0646 31.8871 177.4308 11 Q 4.0088 7.8053 126.6724 57.0303 26.2823 173.9388 12 D 4.8648 8.6040 124.1963 54.6374 39.7085 175.2064 13 V 4.7784 7.4899 118.8230 61.9413 34.6951 173.5822 14 L 4.9019 8.9966 130.7120 53.6929 44.0256 174.8683 15 I 4.6743 9.1719 128.6530 59.9325 39.1099 174.8981 16 V 4.6316 8.9787 128.9286 61.4523 33.3735 174.9448 17 R 4.7358 9.4949 130.0833 54.7455 31.2466 175.4623 18 L 5.0471 8.0377 123.1292 53.7018 43.3501 176.7368 19 S 4.4414 9.1559 116.7002 57.0155 65.5491 171.0154 20 G 4.2653 8.4095 111.8285 44.5111 0.0000 172.5336 21 E 5.0591 9.5329 124.4837 54.5366 32.4878 176.1795 22 L 4.7884 9.4156 126.3392 53.0232 43.3997 174.4129 23 D 5.4408 9.2135 125.0791 50.6726 43.4326 176.3590 24 H 4.0297 9.3377 116.9243 59.9685 29.3446 175.7441 25 H 4.0605 8.2245 117.8164 59.6840 30.1069 176.8793 26 T 4.0259 7.9282 109.8507 64.5529 68.5340 176.1145 27 A 4.0199 8.5597 124.0841 55.3386 17.8487 179.5166 28 E 3.3978 7.8128 115.3261 59.2118 29.4268 179.1325 29 E 4.0024 8.0959 119.7417 58.7361 29.6652 178.4972 30 L 3.9687 7.6938 120.1107 58.0303 41.9586 178.5932 31 R 3.9057 8.8742 119.6119 58.8917 29.7540 177.8801 32 E 3.9204 7.6826 118.1269 58.9356 29.7145 178.2578 33 Q 3.9792 8.0105 117.0128 58.6310 29.0292 178.6459 34 V 3.7210 8.0146 119.6944 66.3096 31.7153 178.0122 35 T 3.9885 7.4221 109.2203 65.3208 68.1069 175.7504 36 D 4.4075 7.7847 120.6504 56.6508 40.6305 178.8472 37 V 3.6550 8.2358 119.4179 65.7760 31.4922 178.0427 38 L 3.7195 7.8792 116.8483 57.6788 41.4581 178.8684 39 E 4.1650 7.9417 117.9246 59.1348 29.6744 178.3403 40 N 4.5672 7.8512 115.2513 53.9865 39.1566 175.6322 41 R 4.6614 8.1122 117.8646 54.1827 33.6114 176.0405 42 A 4.3259 8.1894 124.4628 51.1526 17.1453 175.7487 43 I 3.9942 7.6165 120.9501 60.5885 38.5274 176.0487 44 R 4.2673 8.8189 125.9349 57.8990 31.7063 175.3605 45 H 5.4459 7.8570 113.5980 54.1080 34.0221 172.3905 46 I 5.1014 8.7707 119.3421 59.7535 41.3407 174.7767 47 V 4.7155 9.2005 126.5756 61.1360 34.2677 174.3795 48 L 4.9966 9.3358 128.9719 53.5082 44.7361 174.6347 49 N 5.0888 9.1871 127.4740 52.2379 38.3201 174.3786 50 L 4.5312 8.8287 124.8242 54.4846 41.9959 179.6347 51 G 3.7294 8.5110 111.0338 48.5574 0.0000 175.2590 52 Q 4.4372 7.9453 117.0895 55.2926 28.9607 174.5457 53 L 4.7382 7.4423 121.0929 55.3765 42.0700 176.7334 54 T 4.4797 9.9956 115.8781 63.1234 70.5068 174.4678 55 F 4.8528 7.9124 121.9649 57.5219 43.1034 172.8294 56 M 5.5948 6.8708 120.3499 55.2241 35.8521 174.2066 57 D 5.0390 8.2153 125.8548 52.7217 41.1368 177.4875 58 S 4.2901 8.6676 110.3171 61.7402 63.2186 176.3138 59 S 4.2527 8.6031 119.0529 61.4501 62.5903 177.0254 60 G 3.6009 7.9495 107.2586 47.7903 0.0000 175.8574 61 L 4.2421 7.9431 121.3142 57.3905 41.6890 179.7686 62 G 3.6115 8.3033 106.1583 47.7748 0.0000 176.2755 63 V 3.7343 7.8775 120.8931 64.4624 31.8621 178.3060 64 I 3.9311 7.7670 120.3424 64.0556 36.8041 178.1066 65 L 4.1243 8.2102 121.3742 57.9052 41.4128 179.2600 66 G 3.6193 8.0543 105.9412 47.6719 0.0000 175.8767 67 R 3.8356 7.9189 119.7442 58.7810 29.8342 178.3999 68 Y 3.9180 7.8968 119.3530 60.4206 38.9295 177.3422 69 K 4.2926 7.8628 119.3583 60.0719 31.9925 179.0906 70 Q 3.9949 7.6585 117.4484 59.1405 28.6085 179.3194 71 I 3.8485 7.3264 120.3040 63.6834 37.1896 178.1576 72 K 3.5897 8.4295 121.6544 59.1830 31.7055 178.2425 73 N 4.2556 7.6182 115.8236 56.6768 38.6445 177.0023 74 V 3.9582 6.9732 109.8668 60.5000 32.3472 176.3260 75 G 3.7931 7.9892 106.4406 47.1385 0.0000 172.7331 76 G 4.8241 7.7739 103.8794 43.5258 0.0000 172.8477 77 Q 4.9266 9.0019 117.5956 54.2790 31.6568 174.9229 78 M 4.9292 8.8286 122.2576 54.1188 34.5790 174.4300 79 V 4.7102 8.8968 127.6667 61.1856 34.3303 174.2437 80 V 4.8910 8.7198 129.0323 61.5734 33.2110 174.3719 81 C 5.3548 9.3870 122.1818 55.1189 33.5230 173.1553 82 A 4.0343 8.0270 118.7147 53.2400 15.9389 177.9408 83 V 3.8906 7.6838 120.3474 62.7028 32.8511 175.2600 84 S 4.4534 8.5024 121.7660 57.1931 64.0996 172.9162 85 P 3.9788 0.0000 0.0000 65.8036 30.9498 178.0808 86 A 3.6234 7.9427 119.1867 55.5201 18.4309 179.6093 87 V 3.4063 7.8898 116.6441 66.0298 31.6321 177.9861 88 K 3.6017 7.8555 118.8335 59.8086 31.5145 178.2761 89 R 3.8823 8.4410 119.0500 58.9653 30.1203 178.3822 90 L 4.1639 8.3565 119.3301 57.8378 41.9427 179.0026 91 F 4.4370 8.3006 117.2152 61.1195 38.6690 177.1200 92 D 4.8859 8.5972 116.4869 56.3275 40.7578 177.2397 93 M 4.4662 8.2837 118.1914 56.0515 33.3736 176.7534 94 S 4.5830 8.1104 111.5004 57.0097 64.1838 173.8920 95 G 2.8992 7.8625 110.6033 46.3189 0.0000 175.6762 96 L 3.7937 7.3992 123.4446 56.6914 42.4398 178.6188 97 F 4.3441 7.5555 112.4206 59.0666 37.8146 176.5961 98 K 4.1423 6.7502 118.5542 59.4832 31.7932 178.2937 99 I 3.5360 7.2225 116.4313 62.1403 37.4001 175.5681 100 I 4.3684 7.6445 121.7333 58.8596 40.6419 174.2171 101 R 4.5517 8.3486 129.4680 55.1984 31.7515 175.0110 102 V 5.6660 8.2788 124.5214 60.6634 33.9433 174.2831 103 E 4.6376 8.5260 123.3903 54.4359 33.6552 175.2568 104 A 4.1383 9.0293 122.9520 54.9346 18.9360 178.1757 105 D 5.0736 7.9842 111.1106 50.6233 43.1621 176.1336 106 E 4.0516 8.7530 117.9480 59.7872 29.3913 178.7681 107 Q 3.9975 8.0354 117.4681 58.7348 28.6117 178.3817 108 F 4.2918 8.9446 118.8834 59.6838 39.0340 177.8072 109 A 4.0615 7.6150 119.9850 55.2389 18.2934 179.7232 110 L 4.0298 7.9774 117.3736 57.6926 41.3706 179.5037 111 Q 4.0054 7.6413 119.0813 58.8577 29.0467 177.5629 112 A 4.2096 7.7103 121.3296 53.9476 18.7011 178.2667 113 L 4.5936 7.6819 116.9772 54.3605 43.3363 176.4451 114 G 3.9040 8.8712 102.4624 46.2186 0.0000 174.8776 115 V 3.9802 7.9565 117.9923 61.6712 33.0651 173.7615 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.19 4.52 0.00 3.93 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.84 5.12 0.00 1.90 1.48 1.09 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 4 A 10.60 4.75 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.48 4.50 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.71 0.93 0.00 0.00 6 D 8.95 5.01 0.00 2.79 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.54 5.39 0.00 1.52 1.52 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 8 E 9.44 4.67 0.00 1.95 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 9 V 8.50 4.52 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.93 0.00 0.00 10 K 8.94 4.44 0.00 1.84 1.73 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.46 7.81 11 Q 7.81 4.01 0.00 2.24 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.70 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 12 D 8.60 4.86 0.00 2.78 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.49 4.78 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.00 0.00 0.00 14 L 9.00 4.90 0.00 1.79 1.52 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 15 I 9.17 4.67 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.51 0.93 0.00 0.00 16 V 8.98 4.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.95 0.00 0.00 17 R 9.49 4.74 0.00 1.82 1.87 0.00 3.38 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 18 L 8.04 5.05 0.00 1.60 1.61 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 19 S 9.16 4.44 0.00 3.88 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.41 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 9.53 5.06 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 22 L 9.42 4.79 0.00 1.72 1.67 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 23 D 9.21 5.44 0.00 2.98 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 9.34 4.03 0.00 3.30 3.45 0.00 5.87 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.22 4.06 0.00 3.18 3.35 0.00 5.98 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.93 4.03 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 27 A 8.56 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.81 3.40 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 29 E 8.10 4.00 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 30 L 7.69 3.97 0.00 1.81 1.82 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.87 3.91 0.00 2.05 1.92 0.00 3.14 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 32 E 7.68 3.92 0.00 2.39 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 33 Q 8.01 3.98 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 34 V 8.01 3.72 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 35 T 7.42 3.99 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 36 D 7.78 4.41 0.00 3.06 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.24 3.65 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.00 0.00 0.00 38 L 7.88 3.72 0.00 1.64 1.71 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.94 4.16 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 40 N 7.85 4.57 0.00 2.75 2.86 0.00 0.00 6.85 8.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.11 4.66 0.00 1.82 1.78 0.00 3.15 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 42 A 8.19 4.33 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.62 3.99 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.84 0.95 0.00 0.00 44 R 8.82 4.27 0.00 1.75 1.83 0.00 2.97 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.62 0.00 45 H 7.86 5.45 0.00 3.07 3.31 0.00 5.61 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.77 5.10 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.86 1.02 0.00 0.00 47 V 9.20 4.72 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.96 0.00 0.00 48 L 9.34 5.00 0.00 1.77 1.76 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 49 N 9.19 5.09 0.00 2.92 2.73 0.00 0.00 6.94 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.83 4.53 0.00 1.75 1.62 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.51 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.95 4.44 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.07 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 53 L 7.44 4.74 0.00 1.74 1.55 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 54 T 10.00 4.48 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 55 F 7.91 4.85 0.00 3.15 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 M 6.87 5.59 0.00 1.73 1.72 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 57 D 8.22 5.04 0.00 3.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.67 4.29 0.00 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.60 4.25 0.00 4.16 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.95 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.94 4.24 0.00 1.89 1.75 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.30 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.88 3.73 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.95 0.00 0.00 64 I 7.77 3.93 1.95 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.20 0.90 0.00 0.00 65 L 8.21 4.12 0.00 1.79 1.84 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.05 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 7.92 3.84 0.00 2.06 2.01 0.00 3.31 0.00 0.00 3.10 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 68 Y 7.90 3.92 0.00 3.07 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.86 4.29 0.00 1.98 1.86 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.76 7.81 70 Q 7.66 3.99 0.00 1.84 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 71 I 7.33 3.85 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 0.77 0.00 0.00 72 K 8.43 3.59 0.00 1.36 1.81 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.50 7.81 73 N 7.62 4.26 0.00 2.90 2.84 0.00 0.00 7.11 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 6.97 3.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.96 0.00 0.00 75 G 7.99 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.77 4.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 9.00 4.93 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 78 M 8.83 4.93 0.00 2.47 2.23 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.69 0.00 79 V 8.90 4.71 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.97 0.00 0.00 80 V 8.72 4.89 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.09 0.00 0.00 81 C 9.39 5.35 0.00 3.14 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.03 4.03 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.68 3.89 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.94 0.00 0.00 84 S 8.50 4.45 0.00 4.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 3.98 0.00 2.15 2.08 0.00 3.60 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 86 A 7.94 3.62 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.89 3.41 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.74 0.00 0.00 88 K 7.86 3.60 0.00 1.72 1.85 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.46 7.81 89 R 8.44 3.88 0.00 1.87 2.10 0.00 3.29 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 90 L 8.36 4.16 0.00 1.83 1.76 0.86 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.30 4.44 0.00 3.22 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.60 4.89 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 M 8.28 4.47 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 94 S 8.11 4.58 0.00 4.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.86 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.40 3.79 0.00 1.56 1.27 0.68 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 97 F 7.56 4.34 0.00 3.08 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.75 4.14 0.00 1.55 1.82 0.00 1.46 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 0.72 7.81 99 I 7.22 3.54 1.46 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.22 -0.28 0.00 0.00 100 I 7.64 4.37 1.52 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.55 0.42 0.00 0.00 101 R 8.35 4.55 0.00 1.94 1.79 0.00 3.11 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 102 V 8.28 5.67 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.16 0.00 0.00 103 E 8.53 4.64 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 104 A 9.03 4.14 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 7.98 5.07 0.00 2.91 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.75 4.05 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 107 Q 8.04 4.00 0.00 1.78 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 108 F 8.94 4.29 0.00 3.24 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.62 4.06 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.98 4.03 0.00 1.84 1.73 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 7.64 4.01 0.00 2.14 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 112 A 7.71 4.21 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.68 4.59 0.00 1.65 1.61 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.87 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.96 3.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 1.03 0.00 0.00